1-(5-O-Phosphono-β-D-Ribofuranosyl)-3-Pyridiniumcarboxylate

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Properties Simple | Detailed

Formula C11H13NO9P-
IUPAC Name 1-[(2s,3s,4s,5r)-3,4-dihydroxy-5-[[hydroxy(oxido)phosphoryl]oxymethyl]tetrahydrofuran-2-yl]pyridin-1-ium-3-carboxylate
Molecular Mass 334.196 g·mol−1
Heat of Formation 111.4 ± 16.7 kJ·mol−1
Dipole Moment 5.54 ± 1.08 D
Volume 314.97 Å 3
Surface Area 298.66 Å 2
HOMO Energy -10.15 ± 0.55 eV
LUMO Energy -2.33 ± eV
Point Group Symmetry C1
InChIKey JOUIQRNQJGXQDC-IMSYWVGJSA-O
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